CID 215243
Brn 1252586
Structural Information
- Molecular Formula
- C18H17NO2
- SMILES
- C1CCN(CC1)C2=CC(=O)C3=C(O2)C=CC4=CC=CC=C43
- InChI
- InChI=1S/C18H17NO2/c20-15-12-17(19-10-4-1-5-11-19)21-16-9-8-13-6-2-3-7-14(13)18(15)16/h2-3,6-9,12H,1,4-5,10-11H2
- InChIKey
- CCGRRAZKPQCUGY-UHFFFAOYSA-N
- Compound name
- 3-piperidin-1-ylbenzo[f]chromen-1-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 280.13320 | 161.9 |
[M+Na]+ | 302.11514 | 170.5 |
[M-H]- | 278.11864 | 169.4 |
[M+NH4]+ | 297.15974 | 176.9 |
[M+K]+ | 318.08908 | 166.0 |
[M+H-H2O]+ | 262.12318 | 152.3 |
[M+HCOO]- | 324.12412 | 179.7 |
[M+CH3COO]- | 338.13977 | 173.6 |
[M+Na-2H]- | 300.10059 | 170.1 |
[M]+ | 279.12537 | 161.0 |
[M]- | 279.12647 | 161.0 |